Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8b21153889ae9273bfd700b4a342c736",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 128.438,
"b": 50.400,
"c": 256.796,
"alpha": 90.00,
"beta": 101.94,
"gamma": 90.00
},
"wavelengths": [0.97961],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.600,3.300],
"number_observations": 50038,
"number_observations_unique": 24219,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.333
},
{
"type": "R(meas)",
"value": 0.441
},
{
"type": "R(pim)",
"value": 0.286
},
{
"type": "I/SigI",
"value": 2.700
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.962
}
]
},
"refln_shells": [
{
"resolution_limits": [3.530,3.300],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.114
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.490
}
]
},
{
"resolution_limits": [29.600,9.330],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "Completeness",
"value": 94.100
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}